02_He_2_1.1_1.2_pbe_v1.0.psp8

He    ONCVPSP-4.0.1  r_core=   1.25127   1.13028
      2.0000      2.0000      210716    zatom,zion,pspd
     8      11   1     4   600     0    pspcod,pspxc,lmax,lloc,mmax,r2well
  5.99000000  0.00000000  0.00000000    rchrg fchrg qchrg
     2     1     0     0     0    nproj
     1     1           extension_switch
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   513  5.1200000000000E+00  1.5710647708857E-05  1.5712232340726E-05  0.0000000000000E+00
   514  5.1300000000000E+00  1.5320070326768E-05  1.5321618427577E-05  0.0000000000000E+00
   515  5.1400000000000E+00  1.4939284913403E-05  1.4940797329639E-05  0.0000000000000E+00
   516  5.1500000000000E+00  1.4568043789332E-05  1.4569521347751E-05  0.0000000000000E+00
   517  5.1600000000000E+00  1.4206105598812E-05  1.4207549106907E-05  0.0000000000000E+00
   518  5.1700000000000E+00  1.3853235146654E-05  1.3854645393102E-05  0.0000000000000E+00
   519  5.1800000000000E+00  1.3509203239530E-05  1.3510580994636E-05  0.0000000000000E+00
   520  5.1900000000000E+00  1.3173786531313E-05  1.3175132547441E-05  0.0000000000000E+00
   521  5.2000000000000E+00  1.2846767372341E-05  1.2848082384333E-05  0.0000000000000E+00
   522  5.2100000000000E+00  1.2527933662780E-05  1.2529218388368E-05  0.0000000000000E+00
   523  5.2200000000000E+00  1.2217078709769E-05  1.2218333849977E-05  0.0000000000000E+00
   524  5.2300000000000E+00  1.1914001088124E-05  1.1915227327657E-05  0.0000000000000E+00
   525  5.2400000000000E+00  1.1618504504828E-05  1.1619702512455E-05  0.0000000000000E+00
   526  5.2500000000000E+00  1.1330397667077E-05  1.1331568096006E-05  0.0000000000000E+00
   527  5.2600000000000E+00  1.1049494153547E-05  1.1050637641787E-05  0.0000000000000E+00
   528  5.2700000000000E+00  1.0775612289149E-05  1.0776729459869E-05  0.0000000000000E+00
   529  5.2800000000000E+00  1.0508575023150E-05  1.0509666485024E-05  0.0000000000000E+00
   530  5.2900000000000E+00  1.0248209810183E-05  1.0249276157728E-05  0.0000000000000E+00
   531  5.3000000000000E+00  9.9943484944877E-06  9.9953903083985E-06  0.0000000000000E+00
   532  5.3100000000000E+00  9.7468271973206E-06  9.7478450447914E-06  0.0000000000000E+00
   533  5.3200000000000E+00  9.5054862069692E-06  9.5064806420094E-06  0.0000000000000E+00
   534  5.3300000000000E+00  9.2701698717761E-06  9.2711414355190E-06  0.0000000000000E+00
   535  5.3400000000000E+00  9.0407264960611E-06  9.0416757170649E-06  0.0000000000000E+00
   536  5.3500000000000E+00  8.8170082385180E-06  8.8179356330597E-06  0.0000000000000E+00
   537  5.3600000000000E+00  8.5988710133163E-06  8.5997770856792E-06  0.0000000000000E+00
   538  5.3700000000000E+00  8.3861743938836E-06  8.3870596366373E-06  0.0000000000000E+00
   539  5.3800000000000E+00  8.1787815190527E-06  8.1796464133270E-06  0.0000000000000E+00
   540  5.3900000000000E+00  7.9765590016197E-06  7.9774040173717E-06  0.0000000000000E+00
   541  5.4000000000000E+00  7.7793768393805E-06  7.7802024356560E-06  0.0000000000000E+00
   542  5.4100000000000E+00  7.5871083284413E-06  7.5879149536294E-06  0.0000000000000E+00
   543  5.4200000000000E+00  7.3996299786622E-06  7.4004180707441E-06  0.0000000000000E+00
   544  5.4300000000000E+00  7.2168214313895E-06  7.2175914181819E-06  0.0000000000000E+00
   545  5.4400000000000E+00  7.0385653793856E-06  7.0393176787775E-06  0.0000000000000E+00
   546  5.4500000000000E+00  6.8647474886298E-06  6.8654825088148E-06  0.0000000000000E+00
   547  5.4600000000000E+00  6.6952563222471E-06  6.6959744619491E-06  0.0000000000000E+00
   548  5.4700000000000E+00  6.5299832665230E-06  6.5306849152176E-06  0.0000000000000E+00
   549  5.4800000000000E+00  6.3688224586014E-06  6.3695079967316E-06  0.0000000000000E+00
   550  5.4900000000000E+00  6.2116707161553E-06  6.2123405153420E-06  0.0000000000000E+00
   551  5.5000000000000E+00  6.0584274689537E-06  6.0590818922017E-06  0.0000000000000E+00
   552  5.5100000000000E+00  5.9089946920796E-06  5.9096340939784E-06  0.0000000000000E+00
   553  5.5200000000000E+00  5.7632768408711E-06  5.7639015677912E-06  0.0000000000000E+00
   554  5.5300000000000E+00  5.6211807876182E-06  5.6217911779026E-06  0.0000000000000E+00
   555  5.5400000000000E+00  5.4826157598852E-06  5.4832121440367E-06  0.0000000000000E+00
   556  5.5500000000000E+00  5.3474932803223E-06  5.3480759811859E-06  0.0000000000000E+00
   557  5.5600000000000E+00  5.2157271080960E-06  5.2162964410376E-06  0.0000000000000E+00
   558  5.5700000000000E+00  5.0872331819300E-06  5.0877894550107E-06  0.0000000000000E+00
   559  5.5800000000000E+00  4.9619295644096E-06  4.9624730785555E-06  0.0000000000000E+00
   560  5.5900000000000E+00  4.8397363878279E-06  4.8402674369967E-06  0.0000000000000E+00
   561  5.6000000000000E+00  4.7205758014963E-06  4.7210946728394E-06  0.0000000000000E+00
   562  5.6100000000000E+00  4.6043719202888E-06  4.6048788943097E-06  0.0000000000000E+00
   563  5.6200000000000E+00  4.4910507745358E-06  4.4915461252448E-06  0.0000000000000E+00
   564  5.6300000000000E+00  4.3805402612623E-06  4.3810242563280E-06  0.0000000000000E+00
   565  5.6400000000000E+00  4.2727700966748E-06  4.2732429975713E-06  0.0000000000000E+00
   566  5.6500000000000E+00  4.1676717697858E-06  4.1681338319370E-06  0.0000000000000E+00
   567  5.6600000000000E+00  4.0651784972808E-06  4.0656299702012E-06  0.0000000000000E+00
   568  5.6700000000000E+00  3.9652251796470E-06  3.9656663070793E-06  0.0000000000000E+00
   569  5.6800000000000E+00  3.8677483582402E-06  3.8681793782891E-06  0.0000000000000E+00
   570  5.6900000000000E+00  3.7726861735548E-06  3.7731073188186E-06  0.0000000000000E+00
   571  5.7000000000000E+00  3.6799783246103E-06  3.6803898223086E-06  0.0000000000000E+00
   572  5.7100000000000E+00  3.5895660293074E-06  3.5899681014063E-06  0.0000000000000E+00
   573  5.7200000000000E+00  3.5013919857947E-06  3.5017848491289E-06  0.0000000000000E+00
   574  5.7300000000000E+00  3.4154003348663E-06  3.4157842012585E-06  0.0000000000000E+00
   575  5.7400000000000E+00  3.3315366233653E-06  3.3319116997423E-06  0.0000000000000E+00
   576  5.7500000000000E+00  3.2497477684068E-06  3.2501142569136E-06  0.0000000000000E+00
   577  5.7600000000000E+00  3.1699820225852E-06  3.1703401206961E-06  0.0000000000000E+00
   578  5.7700000000000E+00  3.0921889401346E-06  3.0925388407615E-06  0.0000000000000E+00
   579  5.7800000000000E+00  3.0163193438487E-06  3.0166612354470E-06  0.0000000000000E+00
   580  5.7900000000000E+00  2.9423252928828E-06  2.9426593595551E-06  0.0000000000000E+00
   581  5.8000000000000E+00  2.8701600514100E-06  2.8704864730072E-06  0.0000000000000E+00
   582  5.8100000000000E+00  2.7997780580905E-06  2.8000970103103E-06  0.0000000000000E+00
   583  5.8200000000000E+00  2.7311348962447E-06  2.7314465507282E-06  0.0000000000000E+00
   584  5.8300000000000E+00  2.6641872648357E-06  2.6644917892613E-06  0.0000000000000E+00
   585  5.8400000000000E+00  2.5988929502586E-06  2.5991905084342E-06  0.0000000000000E+00
   586  5.8500000000000E+00  2.5352107987378E-06  2.5355015506907E-06  0.0000000000000E+00
   587  5.8600000000000E+00  2.4731006894790E-06  2.4733847915431E-06  0.0000000000000E+00
   588  5.8700000000000E+00  2.4125235085284E-06  2.4128011134304E-06  0.0000000000000E+00
   589  5.8800000000000E+00  2.3534411233034E-06  2.3537123802461E-06  0.0000000000000E+00
   590  5.8900000000000E+00  2.2958163577122E-06  2.2960814124565E-06  0.0000000000000E+00
   591  5.9000000000000E+00  2.2396129679469E-06  2.2398719628916E-06  0.0000000000000E+00
   592  5.9100000000000E+00  2.1847956189529E-06  2.1850486932122E-06  0.0000000000000E+00
   593  5.9200000000000E+00  2.1313298613977E-06  2.1315771508780E-06  0.0000000000000E+00
   594  5.9300000000000E+00  2.0791821092715E-06  2.0794237467452E-06  0.0000000000000E+00
   595  5.9400000000000E+00  2.0283196180739E-06  2.0285557332524E-06  0.0000000000000E+00
   596  5.9500000000000E+00  1.9787104635702E-06  1.9789411831745E-06  0.0000000000000E+00
   597  5.9600000000000E+00  1.9303235210239E-06  1.9305489688541E-06  0.0000000000000E+00
   598  5.9700000000000E+00  1.8831284449985E-06  1.8833487420016E-06  0.0000000000000E+00
   599  5.9800000000000E+00  1.8370956497184E-06  1.8373109140538E-06  0.0000000000000E+00
   600  5.9900000000000E+00  1.7921962898558E-06  1.7924066369607E-06  0.0000000000000E+00
<INPUT>
#
#ONCVPSP  (Optimized Norm-Conservinng Vanderbilt PSeudopotential)
#scalar-relativistic version 4.0.1 06/04/2019
#
#While it is not required under the terms of the GNU GPL, it is
#suggested that you cite D. R. Hamann, Phys. Rev. B 88, 085117 (2013)
#in any publication utilizing these pseudopotentials.
#
# ATOM AND REFERENCE CONFIGURATION
# atsym  z   nc   nv     iexc    psfile
  He  2.00    0    1       4      psp8
#
#   n    l    f
    1    0    2.00
#
# PSEUDOPOTENTIAL AND OPTIMIZATION
# lmax
    1
#
#   l,   rc,      ep,       ncon, nbas, qcut
    0   1.24687  -0.57931    4    9   8.56270
    1   1.13000   0.05000    4    7   8.65149
#
# LOCAL POTENTIAL
# lloc, lpopt,  rc(5),   dvloc0
    4    5   1.13000      0.00000
#
# VANDERBILT-KLEINMAN-BYLANDER PROJECTORs
# l, nproj, debl
    0    2   1.00000
    1    1   1.00000
#
# MODEL CORE CHARGE
# icmod, fcfact, rcfact
    0   0.00000   0.00000
#
# LOG DERIVATIVE ANALYSIS
# epsh1, epsh2, depsh
  -12.00   12.00    0.02
#
# OUTPUT GRID
# rlmax, drl
    6.00    0.01
#
# TEST CONFIGURATIONS
# ncnf
    0
# nvcnf
#   n    l    f
</INPUT>

<INFO>
# *********************************************************************************************** #
# Copyright (c) 2022 Material Physics & Mechanics Group, Georgia Tech                             #
# Distributed under GNU General Public License 3 (GPL) (https://www.gnu.org/licenses/)            #
# Mostafa Faghih Shojaei, John E. Pask, Andrew J. Medford, and Phanish Suryanarayana.             #
# "Soft and transferable pseudopotentials from multi-objective optimization."                     #
# Computer Physics Communications 283 (2023): 108594. (https://doi.org/10.1016/j.cpc.2022.108594) #
# Acknowledgment: U.S. Department of Energy (DOE), Office of Science (SC): DE-SC0019410           #
# *********************************************************************************************** #
# Ecut (1e-3 Ha/atom accuracy):  27 Ha                                                            #
# Ecut (1e-4 Ha/atom accuracy):  32 Ha                                                            #
# Mesh size (1e-3 Ha/atom accuracy, 12th order FD):  0.29 Bohr                                    #
# Mesh size (1e-4 Ha/atom accuracy, 12th order FD):  0.27 Bohr                                    #
# These are estimates. Actual spacing should always be determined by refining the mesh            #
# (or equivalently increasing Ecut) until desired error is achieved.                              #
# *********************************************************************************************** #
</INFO>